ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008604
RECORD_TITLE: ACETALDEHYDE DIBUTYL ACETAL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SODA AROMATIC CO., LTD.
LICENSE: CC BY-NC-SA

CH$NAME: ACETALDEHYDE DIBUTYL ACETAL
CH$NAME: 1,1-DIBUTOXYETHANE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₀H₂₂O₂
CH$EXACT_MASS: 174.16198
CH$SMILES: CCCCOC(C)OCCCC
CH$IUPAC: InChI=1S/C10H22O2/c1-4-6-8-11-10(3)12-9-7-5-2/h10H,4-9H2,1-3H3
CH$LINK: COMPTOX DTXSID00236125
CH$LINK: INCHIKEY SWTCCCJQNPGXLQ-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:79117

AC$INSTRUMENT: HITACHI M-80B
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 70 eV

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-0pba-9200000000-fda0e8e84e9701e91907
PK$NUM_PEAK: 28
PK$PEAK: m/z int. rel.int.
  15 1.71 17
  18 1.24 12
  26 1.4 14
  27 17.37 174
  29 35.27 353
  31 9.13 91
  39 8.04 80
  41 42.43 424
  42 3.72 37
  43 13.04 130
  44 4.2 42
  45 81.12 811
  46 1.62 16
  53 1.12 11
  55 6.54 65
  56 20.34 203
  57 99.99 999
  58 4.8 48
  61 1.93 19
  72 1.01 10
  83 2.58 26
  85 3.26 33
  100 1.33 13
  101 81.29 813
  102 4.52 45
  103 4.14 41
  159 13.84 138
  160 1.19 12
//